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1470-41-3 | 1H-Indene-1,3(2H)-dione, 2-(2-bromophenyl)-
CAS No: 1470-41-3 Catalog No: AG001EIC MDL No:MFCD00176216
Product Description
Catalog Number:
AG001EIC
Chemical Name:
1H-Indene-1,3(2H)-dione, 2-(2-bromophenyl)-
CAS Number:
1470-41-3
Molecular Formula:
C15H9BrO2
Molecular Weight:
301.1348
MDL Number:
MFCD00176216
IUPAC Name:
2-(2-bromophenyl)indene-1,3-dione
InChI:
InChI=1S/C15H9BrO2/c16-12-8-4-3-7-11(12)13-14(17)9-5-1-2-6-10(9)15(13)18/h1-8,13H
InChI Key:
XCYYDNADXPFCBU-UHFFFAOYSA-N
SMILES:
Brc1ccccc1C1C(=O)c2c(C1=O)cccc2
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.979g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.139g/mol
Monoisotopic Mass:
299.979g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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